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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	d[Leu4,Lys8]VP
Molecular formula	C47H67N11O11S2
IUPAC name	(2S)-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]-1-[(4R,7S,10S,13S,16S)-7-(2-amino-2-oxoethyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-10-(2-methylpropyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
Molecular weight	1026.24
Hydrogen bond acceptor	14
Hydrogen bond donor	11
XlogP	-0.6
Synonyms	BDBM50205309 Vasopressin, 1-deamino-leucyl(4)-lysine(8)- (Deamino-Cys1,Leu4,Lys8)-Vasopressin D03DXK Vasopressin, 1-(3-mercaptopropanoic acid)-4-L-leucine-8-L-lysine- 1-Deamino-4-leu-8-lys-vasopressin d[Leu4,Lys8]-VP AKOS024457446 Vasopressin, 1-deamino-leu(4)-lys(8)- CHEMBL412972 42061-33-6 [ Show all ]
Inchi Key	QGZMLGLFLYCDQT-PEAOEFARSA-N
Inchi ID	InChI=1S/C47H67N11O11S2/c1-27(2)21-32-42(64)56-35(24-38(49)60)45(67)57-36(47(69)58-19-8-12-37(58)46(68)53-31(11-6-7-18-48)41(63)51-25-39(50)61)26-71-70-20-17-40(62)52-33(23-29-13-15-30(59)16-14-29)43(65)55-34(44(66)54-32)22-28-9-4-3-5-10-28/h3-5,9-10,13-16,27,31-37,59H,6-8,11-12,17-26,48H2,1-2H3,(H2,49,60)(H2,50,61)(H,51,63)(H,52,62)(H,53,68)(H,54,66)(H,55,65)(H,56,64)(H,57,67)/t31-,32-,33-,34-,35-,36-,37-/m0/s1
PubChem CID	44419030
ChEMBL	CHEMBL412972
IUPHAR	N/A
BindingDB	50205309
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
278074	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389
278075	Oxytocin receptor	P70536	Oxtr	Rattus norvegicus (Rat)	388
278073	Vasopressin V1a receptor	P30560	Avpr1a	Rattus norvegicus (Rat)	424
278071	Vasopressin V1b receptor	P48974	Avpr1b	Rattus norvegicus (Rat)	425
278072	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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